4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol

C18H16O3 — CID 162961364

IUPAC4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol
SMILESCC=Cc1cc(OC)c2oc(-c3ccc(O)cc3)cc2c1
InChIInChI=1S/C18H16O3/c1-3-4-12-9-14-11-16(13-5-7-15(19)8-6-13)21-18(14)17(10-12)20-2/h3-11,19H,1-2H3
InChIKeyFKFOKMFTSLBPAJ-UHFFFAOYSA-N
MW280.32 g/mol
LogP4.85
Rot. Bonds3

About 4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol

4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol (PubChem CID 162961364) has the molecular formula C18H16O3 and a molecular weight of 280.32 g/mol. Its IUPAC name is 4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol.

Molecular Properties

Compound Name4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol
PubChem CID162961364
Molecular FormulaC18H16O3
Molecular Weight280.32 g/mol
Exact Mass280.11
IUPAC Name4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol
SMILESCC=Cc1cc(OC)c2oc(-c3ccc(O)cc3)cc2c1
InChIInChI=1S/C18H16O3/c1-3-4-12-9-14-11-16(13-5-7-15(19)8-6-13)21-18(14)17(10-12)20-2/h3-11,19H,1-2H3
InChIKeyFKFOKMFTSLBPAJ-UHFFFAOYSA-N
XLogP4.85
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol?
The IUPAC name of 4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol (CID 162961364) is 4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol.
What is the SMILES notation for 4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol?
The canonical SMILES for 4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol is CC=Cc1cc(OC)c2oc(-c3ccc(O)cc3)cc2c1.
What is the InChIKey of 4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol?
The InChIKey is FKFOKMFTSLBPAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16O3/c1-3-4-12-9-14-11-16(13-5-7-15(19)8-6-13)21-18(14)17(10-12)20-2/h3-11,19H,1-2H3.
What are the key properties of 4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol?
4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol has a molecular weight of 280.32 g/mol, XLogP of 4.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol is sourced from PubChem (CID 162961364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).